1-(2-Aminophenyl)-2-methylpropan-1-one

Base Information

• Chemical Name: 1-(2-Aminophenyl)-2-methylpropan-1-one
• CAS No.: 27309-55-3
• Molecular Formula: C10H13NO
• Molecular Weight: 163.219
• European Community (EC) Number: 864-452-8
• DSSTox Substance ID: DTXSID90485827
• Nikkaji Number: J2.989.783B
• Wikidata: Q82325379
• Mol file: 27309-55-3.mol

Synonyms:1-(2-aminophenyl)-2-methylpropan-1-one;27309-55-3;1-Propanone, 1-(2-aminophenyl)-2-methyl-;2-isopropylcarbonylaniline;SCHEMBL637576;SCHEMBL18927435;DTXSID90485827;ZBORFQJDYSRFBH-UHFFFAOYSA-N;CBA30955;AKOS014158397;1-(2-aminophenyl)-2-methyl-1-propanone;1-(2-aminophenyl)-2-methyl-propan-1-one;1-(2-amino-phenyl)-2-methyl-propan-1-one;EN300-119641

Chemical Property of 1-(2-Aminophenyl)-2-methylpropan-1-one

Chemical Property:

• PSA: 43.09000
• LogP: 2.68870
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 163.099714038
• Heavy Atom Count: 12
• Complexity: 165

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(=O)C1=CC=CC=C1N

Technology Process of 1-(2-Aminophenyl)-2-methylpropan-1-one

There total 18 articles about 1-(2-Aminophenyl)-2-methylpropan-1-one which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

N-(2-isobutyryl-phenyl)-2,2-dimethyl-propionamide → 1-(2-aminophenyl)-2-methyl-1-propanone (27309-55-3)

Guidance literature:

N-(2-isobutyryl-phenyl)-2,2-dimethyl-propionamide; With hydrogenchloride; water; In 1,4-dioxane; at 80 ℃; Inert atmosphere;

With sodium hydrogencarbonate; In 1,4-dioxane; water; Inert atmosphere;

DOI:10.1021/ol101040p

Reference yield: 93.0%

isopropylmagnesium chloride (1068-55-9) + anthranilic acid nitrile (1885-29-6) → 1-(2-aminophenyl)-2-methyl-1-propanone (27309-55-3)

Guidance literature:

SiO₂; In diethyl ether; hexane; ethyl acetate;

Reference yield: 88.0%

isopropylmagnesium bromide (920-39-8) + anthranilic acid nitrile (1885-29-6) → 1-(2-aminophenyl)-2-methyl-1-propanone (27309-55-3)

Guidance literature:

In tetrahydrofuran; at 0 - 20 ℃; for 65h; Inert atmosphere;

DOI:10.1039/c4cc05901h

upstream raw materials:

isopropylmagnesium chloride

anthranilic acid nitrile

isopropylmagnesium bromide

C₁₀H₁₅NO

Downstream raw materials:

C,C,C-Trifluoro-N-(2-isobutyryl-phenyl)-methanesulfonamide

2-(4-fluorophenyl)-4-(1-methylethyl)-3-quinoline-carboxylic acid, ethyl ester

Ethyl 3-(2-isobutyrylphenylamino)-3-oxopropanoate

2,2,2-trichloro-N-[2-(isopropylcarbonyl)phenyl]acetamide